BDBM50217316 CHEMBL113084

SMILES: NC(=N)NCCCCCC(=O)N1CCN(CC1)C(=O)COc1ccc(OCC(=O)N2CCN(CC2)C(=O)CCCCCNC(N)=N)cc1

InChI Key: InChIKey=AVUYMOKNWRCTRQ-UHFFFAOYSA-N

Data: 1 KI

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50217316   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Tryptase (Homo sapiens (Human))	BDBM50217316 (CHEMBL113084) Show SMILES NC(=N)NCCCCCC(=O)N1CCN(CC1)C(=O)COc1ccc(OCC(=O)N2CCN(CC2)C(=O)CCCCCNC(N)=N)cc1 Show InChI InChI=1S/C32H52N10O6/c33-31(34)37-13-5-1-3-7-27(43)39-15-19-41(20-16-39)29(45)23-47-25-9-11-26(12-10-25)48-24-30(46)42-21-17-40(18-22-42)28(44)8-4-2-6-14-38-32(35)36/h9-12H,1-8,13-24H2,(H4,33,34,37)(H4,35,36,38)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2.30E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Yoshitomi Pharmaceutical Industries, LTD. Curated by ChEMBL					Assay Description Inhibition of tryptase activity				Bioorg Med Chem Lett 9: 3285-90 (2000) BindingDB Entry DOI: 10.7270/Q2TX3DK3
					More data for this Ligand-Target Pair